Chem
J-GLOBAL ID:201707017420563836   Nikkaji number:J3.580.322J

5-[(S)-1-[(Dimethylphenylsilyl)oxy]-4-heptadecyne-1-yl]-5′-[5-[(R)-2,2-dimethyl-1,3-dioxolane-4-yl]pentyl]octahydro-2,2′-bifuran

5-[(S)-1-[(ジメチルフェニルシリル)オキシ]-4-ヘプタデシン-1-イル]-5′-[5-[(R)-2,2-ジメチル-1,3-ジオキソラン-4-イル]ペンチル]オクタヒドロ-2,2′-ビフラン
Substance type:
Substance type
Substance type classified into 3 categories.
Decided structure: Substances with a clear structure
Undicided Structure: Substances with unknown or undetermined structure
Mixtures: Mixtures, racemic compounds, or compounds with relative structural arrangements
Decided structure
Molecular formula: C43H72O5Si
Molecular formula furigana: C43-H72-O5-SI
Molecular weight: 697.129
InChI: InChI=1S/C43H72O5Si/c1-6-7-8-9-10-11-12-13-14-15-16-17-18-25-30-42(48-49(4,5)38-28-23-20-24-29-38)41-34-33-40(46-41)39-32-31-36(45-39)26-21-19-22-27-37-35-44-43(2,3)47-37/h20,23-24,28-29,36-37,39-42H,6-16,19,21-22,25-27,30-35H2,1-5H3/t36?,37-,39?,40?,41?,42+/m1/s1
InChI key: OJVDBQISVMTSBM-XFQCRTJMSA-N
SMILES: CCCCCCCCCCCCC#CCC[C@H](O[Si](C)(C)c1ccccc1)C1CCC(O1)C1CCC(CCCCC[C@@H]2COC(C)(C)O2)O1
Systematic name  (3):
  • 5-[(S)-1-[(ジメチルフェニルシリル)オキシ]-4-ヘプタデシン-1-イル]-5′-[5-[(R)-2,2-ジメチル-1,3-ジオキソラン-4-イル]ペンチル]オクタヒドロ-2,2′-ビフラン
  • {[(1S)-1-(5'-{5-[(4R)-2,2-ジメチル-1,3-ジオキソラン-4-イル]ペンチル}-[2,2'-ビオキソラン]-5-イル)ヘプタデカ-4-イン-1-イル]オキシ}ジメチルフェニルシラン
  • {[(1S)-1-(5'-{5-[(4R)-2,2-dimethyl-1,3-dioxolan-4-yl]pentyl}-[2,2'-bioxolan]-5-yl)heptadec-4-yn-1-yl]oxy}dimethylphenylsilane
Other name (1):
  • 5-[(S)-1-[(Dimethylphenylsilyl)oxy]-4-heptadecyne-1-yl]-5′-[5-[(R)-2,2-dimethyl-1,3-dioxolane-4-yl]pentyl]octahydro-2,2′-bifuran
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